CAS 124-48-1|Chlorodibromomethane|dibromo(chloro)methane|dibromochloromethane|Monochlorodibromomethane|Dibromo(chloro)methane|Dibromochloromethane|Chlorodibromomethane|二溴氯甲烷|一氯二溴甲烷|Dibrom...

General Information

Structure

Molecular Formula

CHBr₂Cl

Molecular Mass

208.27964

Exact Mass

205.81335171

Charge

InChI

InChI=1S/CHBr2Cl/c2-1(3)4/h1H

InChIKey

GATVIKZLVQHOMN-UHFFFAOYSA-N

Canonic Smiles

ClC(Br)Br

Isomeric Smiles

ClC(Br)Br

Calculated Properties

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

2.1260462

LogD (pH = 7.4)

2.1260462

Log P

2.1260462

Molar Refractivity

26.9843

Polarizability

10.782555

Polar Surface Area

0.0

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

Synonyms

ChlorodibromomethaneMonochlorodibromomethaneDibromochloromethaneChlorodibromomethane二溴氯甲烷一氯二溴甲烷DibromochloromethaneDibromomonochloromethaneDibromochloromethane (stabilized with Ethanol)氯二溴甲烷

IUPAC name

dibromo(chloro)methane

IUPAC Traditional name

dibromochloromethane

IUPAC Systematic name

Dibromo(chloro)methane

Names and Identifiers

Registration numbers

MDL Number

Beilstein Number

EC Number

CAS Number

PubChem SID

24872072160972953248630122485239324860862

PubChem CID

Merck Index

Chemspider ID

KEGG ID

Wikipedia Title

MeSH Name

CHEMBL

Registration numbers

Properties

Related Proteins

No Data Available

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Molecular Spectra

No Data Available

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Molecule Details

Wikipedia

Dibromochloromethane

Sigma Aldrich

206326

Packaging
5, 10, 50 g in glass bottle
Application
Affords bromochlorocarbene under phase-transfer conditions.1

TRC

D425205

A volatile halogenated methane present in trace amounts in drinking water as a result of the water treatment process. It is useful as chain transfer agents in PVC polymerization.

Molecule Details

References

PubChem Literature

From Data Sources

• Stanaback, R.J.: Tech. Pap. Soc. Plast. Engin., 23, 262 (1977)

• Nestmann, E.R. et al.: Water Chlorin. Env. Impact Health. Eff., 4, 1151 (1977)

• Source of bromochlorocarbene in the presence of base and Dibenzo-18-crown-6, A13133. Other conditions give mixtures of carbenes: Synthesis, 783 (1977); Tetrahedron, 33, 363 (1977).

References

Bioactivity

PubChem BioAssay

Bioactivity

Names and Identifiers

Synonyms

IUPAC name

dibromo(chloro)methane

IUPAC Traditional name

dibromochloromethane

IUPAC Systematic name

Dibromo(chloro)methane

Registration numbers

MDL Number

Beilstein Number

EC Number

CAS Number

PubChem SID

24872072160972953248630122485239324860862

PubChem CID

Merck Index

Chemspider ID

KEGG ID

Wikipedia Title

MeSH Name

CHEMBL

Molecule Details

206326

Packaging
5, 10, 50 g in glass bottle
Application
Affords bromochlorocarbene under phase-transfer conditions.1

TRC

D425205

A volatile halogenated methane present in trace amounts in drinking water as a result of the water treatment process. It is useful as chain transfer agents in PVC polymerization.

References

PubChem Literature

From Data Sources

• Stanaback, R.J.: Tech. Pap. Soc. Plast. Engin., 23, 262 (1977)

• Nestmann, E.R. et al.: Water Chlorin. Env. Impact Health. Eff., 4, 1151 (1977)

• Source of bromochlorocarbene in the presence of base and Dibenzo-18-crown-6, A13133. Other conditions give mixtures of carbenes: Synthesis, 783 (1977); Tetrahedron, 33, 363 (1977).

Bioactivity

PubChem BioAssay

Properties

Molecule

ID:9646